Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
2.1867 0.2655 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4190 -0.8704 0.4643 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0675 -0.4252 0.5588 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6675 -0.0895 -0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1609 -0.1679 -1.6888 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0378 0.3569 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5788 0.4419 0.8024 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0030 0.7949 -1.8193 Cl 0 0 0 0 0 0 0 0 0 0 0 0
1.7561 1.2555 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2362 0.2111 0.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1362 0.1111 -1.2931 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7886 -1.0579 1.4892 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4439 -1.7756 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5823 0.7699 0.9047 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0040 0.1796 1.6682 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers